SCHEMBL31160385

SCHEMBL31160385

N#Cc1ccc(CSc2nnc(Cn3c4ccccc4c4ccccc43)n2-c2ccccc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 6/20 0.66
▸ GAA P10253 4/20 0.66
▸ MEN1 O00255 2/20 0.66
▸ KMT2A Q03164 2/20 0.66
▸ SMN1; SMN2 Q16637 2/20 0.60
▸ ATM Q13315 1/20 0.60
▸ ALDH1A1 P00352 4/20 0.57
▸ HTT P42858 3/20 0.57
▸ MAPT P10636 2/20 0.57
▸ MAPK1 P28482 1/20 0.54
▸ LMNA P02545 4/20 0.53
▸ TSHR P16473 3/20 0.52
▸ SIRT2 Q8IXJ6 1/20 0.50
▸ POLB P06746 1/20 0.49
▸ DRD2 P14416 1/20 0.47
▸ TBXA2R P21731 1/20 0.47
▸ RAB9A P51151 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31160388 0.89 SIRT2 (0.58) NPSR1GAAMEN1KMT2ASMN1; SMN2
SCHEMBL31160379 0.89 GAA (0.52) NPSR1GAAMEN1KMT2ASMN1; SMN2
SCHEMBL31160419 0.86 PTGES (0.57) NPSR1GAAMEN1KMT2ASMN1; SMN2
SCHEMBL31160406 0.86 TERT (0.56) NPSR1GAAMEN1KMT2ASMN1; SMN2
SCHEMBL31160454 0.86 L3MBTL1 (0.51) NPSR1GAAMEN1KMT2ASMN1; SMN2
SCHEMBL31160390 0.86 SMN1; SMN2 (0.61) NPSR1GAAMEN1KMT2ASMN1; SMN2
SCHEMBL31160363 0.83 ALDH1A1 (0.62) NPSR1GAAMEN1KMT2ASMN1; SMN2
SCHEMBL31160414 0.83 SIRT2 (0.47) NPSR1GAAMEN1KMT2ASMN1; SMN2
SCHEMBL31160371 0.83 LMNA (0.53) NPSR1GAAMEN1KMT2ASMN1; SMN2
SCHEMBL31160341 0.81 SIRT2 (0.66) NPSR1GAAMEN1KMT2ASMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119019374-A Carbazole compound for preventing and treating plant pathogenic bacteria, and synthetic method and application thereof 贵州大学 2024-11-26 — — CN claimed
CN-119019374-A Carbazole compound for preventing and treating plant pathogenic bacteria, and synthetic method and application thereof 贵州大学 2024-11-26 — — CN disclosed
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